Pyrazine, 2-chloro-3-methyl-, 1-oxide
TL;DR: Pyrazine, 2-chloro-3-methyl-, 1-oxide (CAS 61689-42-7) is a chemical compound with molecular formula C5H5ClN2O and molecular weight 144.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-3-methyl-1-oxidopyrazin-1-ium
Also Known As: 2-Chloro-3-methylpyrazine 1-oxide, 2-chloro-3-methyl-1-oxidopyrazin-1-ium, Pyrazine, 2-chloro-3-methyl-, 1-oxide, 2-Chloro-3-methylpyrazine1-oxide, 2-CHLORO-3-METHYLPYRAZINE HCL
| Molecular Formula | C5H5ClN2O |
|---|---|
| Molecular Weight | 144.01 g/mol |
| LogP | 0.67682 |
| Topological Polar Surface Area | 39.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 144.00903 |
| Heavy Atoms | 9 |
| Complexity | 205.94803 |
Chemical Identifiers
| CAS Number | 61689-42-7 |
|---|---|
| SMILES | CC1=NC=C[N+](=C1Cl)[O-] |
Product Overview
Pyrazine, 2-chloro-3-methyl-, 1-oxide (CAS 61689-42-7), with molecular formula C5H5ClN2O and molecular weight 144.01 g/mol. IUPAC: 2-chloro-3-methyl-1-oxidopyrazin-1-ium.
Chemical Property Profile of Pyrazine, 2-chloro-3-methyl-, 1-oxide
Property Insights of Pyrazine, 2-chloro-3-methyl-, 1-oxide
The XLogP value of 0.67682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrazine, 2-chloro-3-methyl-, 1-oxide. With a topological polar surface area (TPSA) of 39.83 Ų, Pyrazine, 2-chloro-3-methyl-, 1-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrazine, 2-chloro-3-methyl-, 1-oxide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pyrazine, 2-chloro-3-methyl-, 1-oxide?
The CAS number of Pyrazine, 2-chloro-3-methyl-, 1-oxide is 61689-42-7.
What is the molecular formula of Pyrazine, 2-chloro-3-methyl-, 1-oxide?
The molecular formula of Pyrazine, 2-chloro-3-methyl-, 1-oxide is C5H5ClN2O.
What is the molecular weight of Pyrazine, 2-chloro-3-methyl-, 1-oxide?
The molecular weight of Pyrazine, 2-chloro-3-methyl-, 1-oxide is 144.01 g/mol.
Where can I buy Pyrazine, 2-chloro-3-methyl-, 1-oxide?
You can request a quote for Pyrazine, 2-chloro-3-methyl-, 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrazine, 2-chloro-3-methyl-, 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for Pyrazine, 2-chloro-3-methyl-, 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.